相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。Bulk fatigue induced by surface reconstruction in layered Ni-rich cathodes for Li-ion batteries
Chao Xu et al.
NATURE MATERIALS (2021)
Delocalized Metal-Oxygen π-Redox Is the Origin of Anomalous Nonhysteretic Capacity in Li-Ion and Na-Ion Cathode Materials
Daniil A. Kitchaev et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2021)
Pillar-beam structures prevent layered cathode materials from destructive phase transitions
Yuesheng Wang et al.
NATURE COMMUNICATIONS (2021)
Structural evolution and electrochemistry of the Mn-Rich P2-Na2/3Mn0.9Ti0.05Fe0.05O2 positive electrode material
Jennifer H. Stansby et al.
ELECTROCHIMICA ACTA (2020)
Intrinsic Kinetic Limitations in Substituted Lithium-Layered Transition-Metal Oxide Electrodes
Antonin Grenier et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2020)
Design Rules for High-Valent Redox in Intercalation Electrodes
William E. Gent et al.
JOULE (2020)
Recent advances and prospects of layered transition metal oxide cathodes for sodium-ion batteries
Rui-Min Gao et al.
ENERGY STORAGE MATERIALS (2020)
Understanding the redox process upon electrochemical cycling of the P2-Na0.78Co1/2Mn1/3Ni1/6O2 electrode material for sodium-ion batteries
Charifa Hakim et al.
COMMUNICATIONS CHEMISTRY (2020)
Evolution of Structure and Lithium Dynamics in LiNi0.8Mn0.1Co0.1O2 (NMC811) Cathodes during Electrochemical Cycling
Katharina Marker et al.
CHEMISTRY OF MATERIALS (2019)
Metal-oxygen decoordination stabilizes anion redox in Li-rich oxides
Jihyun Hong et al.
NATURE MATERIALS (2019)
What Triggers Oxygen Loss in Oxygen Redox Cathode Materials?
Robert A. House et al.
CHEMISTRY OF MATERIALS (2019)
Understanding the Low-Voltage Hysteresis of Anionic Redox in Na2Mn3O7
Bohang Song et al.
CHEMISTRY OF MATERIALS (2019)
Stabilization of O-O Bonds by d0 Cations in Li4+xNi1-xWO6 (0 ≤ x ≤ 0.25) Rock Salt Oxides as the Origin of Large Voltage Hysteresis
Zoe N. Taylor et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2019)
Charge Transfer Band Gap as an Indicator of Hysteresis in Li-Disordered Rock Salt Cathodes for Li-Ion Batteries
Quentin Jacquet et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2019)
Probing the thermal effects of voltage hysteresis in anionic redox-based lithium-rich cathodes using isothermal calorimetry
Gaurav Assat et al.
NATURE ENERGY (2019)
P2-Na0.67AlxMn1-xO2: Cost-Effective, Stable and High-Rate Sodium Electrodes by Suppressing Phase Transitions and Enhancing Sodium Cation Mobility
Xiangsi Liu et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2019)
Oxygen redox chemistry without excess alkali-metal ions in Na-2/3[Mg0.28Mn0.72]O-2
Urmimala Maitra et al.
NATURE CHEMISTRY (2018)
Sodium and Sodium-Ion Batteries: 50 Years of Research
Claude Delmas
ADVANCED ENERGY MATERIALS (2018)
Quantum-mechanical condensed matter simulations with CRYSTAL
Roberto Dovesi et al.
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2018)
Iron migration and oxygen oxidation during sodium extraction from NaFeO2
Yejing Li et al.
NANO ENERGY (2018)
On Disrupting the Na+-Ion/Vacancy Ordering in P2-Type Sodium-Manganese-Nickel Oxide Cathodes for Na+-Ion Batteries
Arturo Gutierrez et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2018)
Anionic Redox Activity in a Newly Zn-Doped Sodium Layered Oxide P2-Na2/3Mn1-yZnyO2 (0 < y < 0.23)
Xue Bai et al.
ADVANCED ENERGY MATERIALS (2018)
Coupling between oxygen redox and cation migration explains unusual electrochemistry in lithium-rich layered oxides
William E. Gent et al.
NATURE COMMUNICATIONS (2017)
Narrowing the Gap between Theoretical and Practical Capacities in Li-Ion Layered Oxide Cathode Materials
Maxwell D. Radin et al.
ADVANCED ENERGY MATERIALS (2017)
Preventing Structural Rearrangements on Battery Cycling: A First-Principles Investigation of the Effect of Dopants on the Migration Barriers in Layered Li0.5MnO2
Ieuan D. Seymour et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2016)
Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional
Jianwei Sun et al.
NATURE CHEMISTRY (2016)
Versatile van der Waals Density Functional Based on a Meta-Generalized Gradient Approximation
Haowei Peng et al.
PHYSICAL REVIEW X (2016)
A Comparative Study of Layered Transition Metal Oxide Cathodes for Application in Sodium-Ion Battery
Ivana Hasa et al.
ACS APPLIED MATERIALS & INTERFACES (2015)
Mapping Structural Changes in Electrode Materials: Application of the Hybrid Eigenvector-Following Density Functional Theory (DFT) Method to Layered Li0.5MnO2
Ieuan D. Seymour et al.
CHEMISTRY OF MATERIALS (2015)
2H and 27Al Solid-State NMR Study of the Local Environments in Al-Doped 2-Line Ferrihydrite, Goethite, and Lepidocrocite
Jongsik Kim et al.
CHEMISTRY OF MATERIALS (2015)
Mg-doping for improved long-term cyclability of layered Na-ion cathode materials - The example of P2-type NaxMg0.11Mn0.89O2
Daniel Buchholz et al.
JOURNAL OF POWER SOURCES (2015)
Review-Manganese-Based P2-Type Transition Metal Oxides as Sodium-Ion Battery Cathode Materials
Raphaele J. Clement et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2015)
Strongly Constrained and Appropriately Normed Semilocal Density Functional
Jianwei Sun et al.
PHYSICAL REVIEW LETTERS (2015)
Research Development on Sodium-Ion Batteries
Naoaki Yabuuchi et al.
CHEMICAL REVIEWS (2014)
Identifying the Critical Role of Li Substitution in P2-Nax[LiyNizMn1-y-z]O2 (0 < x, y, z < 1) Intercalation Cathode Materials for High-Energy Na-Ion Batteries
Jing Xu et al.
CHEMISTRY OF MATERIALS (2014)
P2-NaxMn1/2Fe1/2O2 Phase Used as Positive Electrode in Na Batteries: Structural Changes Induced by the Electrochemical (De)intercalation Process
Benoit Mortemard de Boisse et al.
INORGANIC CHEMISTRY (2014)
Benchmarks for Characterization of Minima, Transition States, and Pathways in Atomic, Molecular, and Condensed Matter Systems
Samuel T. Chill et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2014)
β-NaMnO2: A High-Performance Cathode for Sodium-Ion Batteries
Juliette Billaud et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2014)
Operando Structural Characterization of the Lithium-Substituted Layered Sodium-Ion Cathode Material P2-Na0.85Li0.17Ni0.21Mn0.64O2 by X-ray Absorption Spectroscopy
Naba K. Karan et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2014)
Direct visualization of the Jahn-Teller effect coupled to Na ordering in Na5/8MnO2
Xin Li et al.
NATURE MATERIALS (2014)
Sodium-Ion Batteries
Michael D. Slater et al.
ADVANCED FUNCTIONAL MATERIALS (2013)
Density Functional Theory-Based Bond Pathway Decompositions of Hyperfine Shifts: Equipping Solid-State NMR to Characterize Atomic Environments in Paramagnetic Materials
Derek S. Middlemiss et al.
CHEMISTRY OF MATERIALS (2013)
Update on Na-based battery materials. A growing research path
Veronica Palomares et al.
ENERGY & ENVIRONMENTAL SCIENCE (2013)
Na-ion batteries, recent advances and present challenges to become low cost energy storage systems
Veronica Palomares et al.
ENERGY & ENVIRONMENTAL SCIENCE (2012)
Isotropic High Field NMR Spectra of Li-Ion Battery Materials with Anisotropy >1 MHz
Ivan Hung et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
Spin-Transfer Pathways in Paramagnetic Lithium Transition-Metal Phosphates from Combined Broadband Isotropic Solid-State MAS NMR Spectroscopy and DFT Calculations
Raphaele J. Clement et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
Enabling Sodium Batteries Using Lithium-Substituted Sodium Layered Transition Metal Oxide Cathodes
Donghan Kim et al.
ADVANCED ENERGY MATERIALS (2011)
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
Stefan Grimme et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Linking Local Environments and Hyperfine Shifts: A Combined Experimental and Theoretical 31P and 7Li Solid-State NMR Study of Paramagnetic Fe(III) Phosphates
Jongsik Kim et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
An investigation of the sodium patterning in NaxCoO2 (0.5≤x≤1) by density functional theory methods
Ying S. Meng et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Electrodes with high power and high capacity for rechargeable lithium batteries
KS Kang et al.
SCIENCE (2006)
High-resolution X-ray diffraction, DIFFaX, NMR and first principles study of disorder in the Li2MnO3-Li[Ni1/2Mn1/2]O2 solid solution
J Bréger et al.
JOURNAL OF SOLID STATE CHEMISTRY (2005)
First-principles prediction of redox potentials in transition-metal compounds with LDA + U -: art. no. 235121
F Zhou et al.
PHYSICAL REVIEW B (2004)
Synthesis and characterization of high-temperature hexagonal P2-Na0.6MnO2 and its electrochemical behaviour as cathode in sodium cells
A Caballero et al.
JOURNAL OF MATERIALS CHEMISTRY (2002)
Transition states and rearrangement mechanisms from hybrid eigenvector-following and density functional theory.: Application to C10H10 and defect migration in crystalline silicon
Y Kumeda et al.
CHEMICAL PHYSICS LETTERS (2001)
分享论文
